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CHEBI:74119 - (3S)-3-methyl-2-oxo-3-phenylpropanoate

ChEBI IDCHEBI:74119
ChEBI Name(3S)-3-methyl-2-oxo-3-phenylpropanoate
Stars
ASCII Name(3S)-3-methyl-2-oxo-3-phenylpropanoate
DefinitionA 2-oxo monocarboxylic acid anion that is the conjugate base of (3S)-3-methyl-2-oxo-3-phenylpropanoic acid, obtained by deprotonation of the carboxy group.
Last Modified3 January 2014
SubmitterKAX
DownloadsMolfile
FormulaC10H9O3
Net Charge-1
Average Mass177.179
Monoisotopic Mass177.05572
SMILESC[C@H](C(=O)C(=O)[O-])c1ccccc1
InChIInChI=1S/C10H10O3/c1-7(9(11)10(12)13)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,13)/p-1/t7-/m0/s1
InChIKeyAXLLOSUYAVXOIN-ZETCQYMHSA-M
ChEBI Ontology
Outgoing Relation(s)
(3S)-3-methyl-2-oxo-3-phenylpropanoate (CHEBI:74119) is a 2-oxo monocarboxylic acid anion (CHEBI:35179)
(3S)-3-methyl-2-oxo-3-phenylpropanoate (CHEBI:74119) is conjugate base of (3S)-3-methyl-2-oxo-3-phenylpropanoic acid (CHEBI:74122)
Incoming Relation(s)
(3S)-3-methyl-2-oxo-3-phenylpropanoic acid (CHEBI:74122) is conjugate acid of (3S)-3-methyl-2-oxo-3-phenylpropanoate (CHEBI:74119)
IUPAC Name 
(3S)-2-oxo-3-phenylbutanoate
Synonyms  Source
(3S)-2-oxo-3-phenylbutyrateChEBI
(3S)-3-methyl-2-oxo-3-phenylpropionateChEBI
(3S)-2-keto-3-phenylbutyrateChEBI
(3S)-2-keto-3-phenylbutanoateChEBI
(3S)-3-methyl-2-keto-3-phenylpropanoateChEBI
(3S)-3-methyl-2-keto-3-phenylpropionateChEBI
UniProt Name  Source
(3S)-2-oxo-3-phenylbutanoateUniProt
Manual XrefsDatabases
CPD-15344MetaCyc
Citations